N-(butylcarbamoyl)-2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(butylcarbamoyl)-2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(butylcarbamoyl)-2-[7-chloro-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-[butylamino(oxo)methyl]-2-[[7-chloro-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(butylcarbamoyl)-2-[7-chloro-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(butylcarbamoyl)-2-[[7-chloro-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]propionamide Formula: C19H25ClN4O4S MolecularWeight: 440.9442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)C(C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCOC

Isomeric SMILES

CCCCNC(=O)NC(=O)C(C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCOC

InChI

InChI=1S/C19H25ClN4O4S/c1-4-5-8-21-18(27)23-16(25)12(2)29-19-22-15-11-13(20)6-7-14(15)17(26)24(19)9-10-28-3/h6-7,11-12H,4-5,8-10H2,1-3H3,(H2,21,23,25,27)